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4-[(cyclooctylazaniumyl)methyl]benzoate

4-[(cyclooctylazaniumyl)methyl]benzoate

Systemtic Name:4-[(cyclooctylazaniumyl)methyl]benzoate
Openeye Name:4-[(cyclooctylammonio)methyl]benzoate
CAS Name:4-[(cyclooctylammonio)methyl]benzoate
IUPAC Name:4-[(cyclooctylazaniumyl)methyl]benzoate
Traditional Name:4-[(cyclooctylammonio)methyl]benzoate
Formula: C16H23NO2
MolecularWeight: 261.35932
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC2=CC=C(C=C2)C(=O)[O-]


Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC2=CC=C(C=C2)C(=O)[O-]


InChI

InChI=1S/C16H23NO2/c18-16(19)14-10-8-13(9-11-14)12-17-15-6-4-2-1-3-5-7-15/h8-11,15,17H,1-7,12H2,(H,18,19)


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